methyl N-[4-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)butanoyl]glycinate
Chemical Structure Depiction of
methyl N-[4-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)butanoyl]glycinate
methyl N-[4-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)butanoyl]glycinate
Compound characteristics
| Compound ID: | Y042-7268 |
| Compound Name: | methyl N-[4-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)butanoyl]glycinate |
| Molecular Weight: | 407.42 |
| Molecular Formula: | C22 H21 N3 O5 |
| Smiles: | COC(CNC(CCCN1C2c3ccccc3C(N2c2ccccc2C1=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6163 |
| logD: | 0.6163 |
| logSw: | -2.1161 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.024 |
| InChI Key: | PWWDDPHXOCYWLI-HXUWFJFHSA-N |